Compound Detail
CHEMBL1410925
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Basic Information
| ChEMBL ID | CHEMBL1410925 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UFHHXODVLHXSSL-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
390.5
MW (Da)
3.58
ALogP
6
HBA
1
HBD
73.6
PSA (Ų)
0.71
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein GLI1 CHEMBL5007 | IC50 | 5.83 | 5.83 | 1470.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.11 | 5.11 | 7840.0 | 1 |
| HEK293 CHEMBL614818 | IC50 | 4.17 | 4.17 | 67700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein GLI1 | IC50 | = | 1470.0 | nM | 5.83 | PubChem BioAssay. Dose response confirmation of uHTS antagonist hits from Gli-SU... | - |
| Unchecked | IC50 | = | 7840.0 | nM | 5.11 | PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of B-cell specific a... | - |
| HEK293 | IC50 | = | 67700.0 | nM | 4.17 | PUBCHEM_BIOASSAY: SAR Analysis of small molecule inhibitors of B-cell specific a... | - |
Data from ChEMBL 36 via Core Engine